2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one
TL;DR: 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one (CAS 23458-50-6) is a chemical compound with molecular formula C14H18N2O and molecular weight 230.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one
Also Known As: 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one, 2-(1H-benzimidazol-2-yl)-2,4-dimethyl-3-pentanone, 2-(1H-1,3-Benzimidazol-2-yl)-2,4-dimethylpentan-3-one, RefChem:249897
| Molecular Formula | C14H18N2O |
|---|---|
| Molecular Weight | 230.14 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.1419 |
| Heavy Atoms | 17 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 23458-50-6 |
|---|---|
| SMILES | CC(C)C(=O)C(C)(C)C1=NC2=CC=CC=C2N1 |
| InChIKey | WIHKPWWWRFYGJH-UHFFFAOYSA-N |
Product Overview
2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one (CAS 23458-50-6), with molecular formula C14H18N2O and molecular weight 230.14 g/mol. IUPAC: 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one.
Chemical Property Profile of 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one
Property Insights of 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one
The XLogP value of 3.4 indicates that 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one?
The CAS number of 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one is 23458-50-6.
What is the molecular formula of 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one?
The molecular formula of 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one is C14H18N2O.
What is the molecular weight of 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one?
The molecular weight of 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one is 230.14 g/mol.
Where can I buy 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one?
You can request a quote for 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-benzimidazol-2-yl)-2,4-dimethylpentan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.